SpectraBase Spectrum ID |
CeXcRGNWFLY |
Name |
3,4,5-Triazatetracyclo[5.5.1.0(2,6).0(8,12)]trideca-3,10-diene, 5-[(4-methylphenyl)sulfonyl]- |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H19N3O2S |
InChI |
InChI=1S/C17H19N3O2S/c1-10-5-7-11(8-6-10)23(21,22)20-17-15-9-14(16(17)18-19-20)12-3-2-4-13(12)15/h2-3,5-8,12-17H,4,9H2,1H3 |
InChIKey |
XAGFDLUKDSVZOM-UHFFFAOYSA-N |
Molecular Weight |
329.418 g/mol |
SMILES |
Cc1ccc(S(N2C3C(C4CC3C3C4C=CC3)N=N2)(=O)=O)cc1 |
SPLASH |
splash10-001r-9370000000-5f5b2b5cebaeeb4c81d8 |
Wiley ID |
1466453 |